Vitas-M small molecule compound

{2-ethoxy-4-[(Z)-(3-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-6-(prop-2-en-1-yl)phenoxy}acetic acid

Catalog ID
STK153440
SMILES CCOc1cc(/C=C/2\SC(=O)N(C2=O)CC(=O)Nc2ccc(cc2)C)cc(c1OCC(=O)O)CC=C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C26H26N2O7S MW 510.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O7S/c1-4-6-18-11-17(12-20(34-5-2)24(18)35-15-23(30)31)13-21-25(32)28(26(33)36-21)14-22(29)27-19-9-7-16(3)8-10-19/h4,7-13H,1,5-6,14-15H2,2-3H3,(H,27,29)(H,30,31)/b21-13-
InChIKey
FQZIACYGHQXYRQ-BKUYFWCQSA-N
Synonyms

(2ETHOXY4((Z)(3(2((4METHYLPHENYL)AMINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)6(PROP2EN1YL)PHENOXY)ACETICACID
2(2ETHOXY4((3((N(4METHYLPHENYL)CARBAMOYL)METHYL)24DIOXO(13THIAZOLIDIN5YLIDENE))METHYL)6PROP2ENYLPHENOXY)ACETICACID
2(2ETHOXY4((Z)(3(2(4METHYLANILINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)6PROP2ENYLPHENOXY)ACETICACID
CCOC1=CC(=CC(=C1OCC(=O)O)CC=C)C=C2C(=O)N(C(=O)S2)CC(=O)NC3=CC=C(C=C3)C
CCOc1cc(C=C2SC(=O)N(C2=O)CC(=O)Nc2ccc(cc2)C)cc(c1OCC(=O)O)CC=C
InChI=1SC26H26N2O7Sc146181117(1220(3452)24(18)351523(30)31)132125(32)28(26(33)3621)1422(29)27199716(3)81019h4713H1561415H223H3(H2729)(H3031)b2113
MFCD03080095
ZINC000008815732
ZINC8815732

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Available files

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